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Information card for entry 7039338
Preview
Coordinates | 7039338.cif |
---|---|
Original paper (by DOI) | HTML |
Formula | C38 H40 Ag2 Cl2 N4 |
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Calculated formula | C38 H40 Ag2 Cl2 N4 |
SMILES | C1(=N(C=CN1Cc1ccc(cc1)C)Cc1ccc(cc1)C)=[Ag]1[Cl][Ag](=C2N(C=CN2Cc2ccc(cc2)C)Cc2ccc(cc2)C)[Cl]1 |
Title of publication | Carboxylation of terminal alkynes with CO2 using novel silver N-heterocyclic carbene complexes. |
Authors of publication | Li, Shanshan; Sun, Jing; Zhang, Zhizhi; Xie, Ruixia; Fang, Xiangchen; Zhou, Mingdong |
Journal of publication | Dalton transactions (Cambridge, England : 2003) |
Year of publication | 2016 |
Journal volume | 45 |
Journal issue | 26 |
Pages of publication | 10577 - 10584 |
a | 9.992 ± 0.005 Å |
b | 8.977 ± 0.004 Å |
c | 19.725 ± 0.009 Å |
α | 90° |
β | 91.261 ± 0.009° |
γ | 90° |
Cell volume | 1768.9 ± 1.4 Å3 |
Cell temperature | 193 ± 2 K |
Ambient diffraction temperature | 193 ± 2 K |
Number of distinct elements | 5 |
Space group number | 14 |
Hermann-Mauguin space group symbol | P 1 21/c 1 |
Hall space group symbol | -P 2ybc |
Residual factor for all reflections | 0.1477 |
Residual factor for significantly intense reflections | 0.1047 |
Weighted residual factors for significantly intense reflections | 0.2673 |
Weighted residual factors for all reflections included in the refinement | 0.2929 |
Goodness-of-fit parameter for all reflections included in the refinement | 1.141 |
Diffraction radiation wavelength | 0.71073 Å |
Diffraction radiation type | MoKα |
Has coordinates | Yes |
Has disorder | Yes |
Has Fobs | No |
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The link is: https://www.crystallography.net/7039338.html
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